Sisyphus repository
Last update: 12 december 2018 | SRPMs: 18652 | Visits: 12696613
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Group :: Sciences/Chemistry

BALL

Maintainer: Grigory Ustinov
Current version: 1.4.3_beta1.793.git37fc53c-alt1
Build time: 25 october 2018, 15:07 (7.0 weeks ago)
Summary: Biochemical Algorithms Library
Changes:

- Initial build for Sisyphus (Closes: #21629).

DSR

Maintainer: Denis G. Samsonenko
Current version: 205-alt1
Build time: 4 january 2018, 10:16 (49.0 weeks ago)
Summary: DSR - A program for modelling of disordered solvents with SHELXL
Changes:

- initial build for ALT

RasMol

Maintainer: Michael Shigorin
Current version: 2.7.5.2-alt3
Build time: 22 april 2012, 12:44 (346.5 weeks ago)
Summary: Molecular Graphics Visualisation Tool
Changes:

- rebuilt with current NearTree

abinit

Maintainer: Ilya Mashkin
Current version: 6.0.4-alt1.qa1
Build time: 16 april 2013, 21:12 (295.2 weeks ago)
Summary: Computational Chemistry DFT program
Changes:

- NMU: rebuilt for debuginfo.

avogadro

Maintainer: Sergey V Turchin
Current version: 1.2.0-alt4.S1
Build time: 6 june 2018, 03:48 (27.2 weeks ago)
Summary: An advanced molecular editor for chemical purposes
Changes:

- NMU: rebuilt with boost-1.67.0

bodr

Maintainer: Yuri N. Sedunov
Current version: 10-alt1
Build time: 3 january 2014, 21:38 (257.8 weeks ago)
Summary: Blue Obelisk Data Repository
Changes:

- new version

chemtool

Maintainer: Michael Shigorin
Current version: 1.6.14-alt1
Build time: 18 june 2014, 17:34 (234.1 weeks ago)
Summary: A program for 2D drawing organic molecules
Changes:

- new version (watch file uupdate)

eperiodique

Maintainer: Yuri N. Sedunov
Current version: 0.5-alt1
Build time: 29 january 2014, 14:24 (254.1 weeks ago)
Summary: A Periodic Table of Elements for Enlightenment
Changes:

- first build for Sisyphus

gnome-chemistry-utils

Maintainer: Yuri N. Sedunov
Current version: 0.14.17-alt8
Build time: 10 august 2018, 09:06 (17.9 weeks ago)
Summary: A set of chemical utilities
Changes:

- disabled gnumeric support incompatible with 1.12.42

gperiodic

Maintainer: Michael Shigorin
Current version: 3.0.2-alt1
Build time: 23 january 2017, 10:45 (98.4 weeks ago)
Summary: Program for browsing the periodic table
Changes:

- new version (watch file uupdate)

gromacs

Maintainer: Michael Shigorin
Current version: 4.0.7-alt8
Build time: 11 august 2012, 20:18 (330.6 weeks ago)
Summary: Molecular dynamics package
Changes:

- Built with OpenBLAS instead of GotoBLAS2

gromacs-gui

Maintainer: Eugeny A. Rostovtsev (REAL)
Current version: 0.5.2-alt6
Build time: 5 december 2012, 11:17 (314.1 weeks ago)
Summary: GUI for molecular dynamics package, GROMACS
Changes:

- Fixed build with glibc 2.16

mmcalc

Maintainer: Denis G. Samsonenko
Current version: 20170901-alt1
Build time: 1 september 2017, 17:28 (66.8 weeks ago)
Summary: Molar Mass Calculator
Changes:

- new version

openbabel

Maintainer: Michael Shigorin
Current version: 2.4.1-alt3
Build time: 23 may 2018, 08:50 (29.1 weeks ago)
Summary: Chemistry software file format converter
Changes:

- NMU: fixed build with new toolchain.

platon

Maintainer: Denis G. Samsonenko
Current version: 20181101-alt1
Build time: 4 november 2018, 14:01 (5.5 weeks ago)
Summary: PLATON is a versatile SHELX compatible multipurpose crystallographic tool
Changes:

- nuw version

pymol

Maintainer: Aleksei Nikiforov
Current version: 1.8.6.0-alt1
Build time: 13 march 2018, 15:46 (39.2 weeks ago)
Summary: Python-enhanced molecular graphics tool
Changes:

- Updated to upstream version 1.8.6.0.

shelxle

Maintainer: Denis G. Samsonenko
Current version: 1.0.940-alt1
Build time: 4 november 2018, 13:48 (5.5 weeks ago)
Summary: A Qt GUI for SHELX
Changes:

- new version

xcrysden

Maintainer: Michael Shigorin
Current version: 1.5.21-alt6
Build time: 2 october 2018, 15:42 (10.2 weeks ago)
Summary: X-window CRYstalline Structure and DENsities
Changes:

- Remove dependency on ImageMagick.

xdrawchem

Maintainer: Vitaly Lipatov
Current version: 1.10.2-alt1
Build time: 24 june 2018, 02:46 (24.6 weeks ago)
Summary: XDrawChem is a two-dimensional molecule drawing program
Changes:

- new version (1.10.2) with rpmgs script
- build with Qt5

xmolwt

Maintainer: Michael Shigorin
Current version: 0.7-alt1
Build time: 26 february 2014, 13:22 (250.1 weeks ago)
Summary: Molecular Weight & Elemental Analysis Calculator
Changes:

- rebuilt for Sisyphus, thanks ogion@
 
design & coding: Vladimir Lettiev aka crux © 2004-2005, Andrew Avramenko aka liks © 2007-2008
current maintainer: Michael Shigorin